Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1dtw_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N VAL 185.A O no hydrogen 3.220 N/A LYS 4.A NZ GLU 184.A OE1 no hydrogen 2.550 N/A MET 5.A N GLU 183.A O no hydrogen 2.692 N/A PHE 8.A N TYR 178.A O no hydrogen 3.307 N/A GLN 9.A N ASN 6.A O no hydrogen 3.027 N/A SER 10.A N ASN 6.A O no hydrogen 2.934 N/A SER 10.A OG ASN 6.A O no hydrogen 3.382 N/A SER 10.A OG LEU 7.A O no hydrogen 2.605 N/A SER 10.A OG PRO 152.A O no hydrogen 3.121 N/A VAL 11.A N LEU 7.A O no hydrogen 3.158 N/A THR 12.A N PHE 8.A O no hydrogen 3.279 N/A THR 12.A OG1 PHE 8.A O no hydrogen 3.099 N/A THR 12.A OG1 CYS 40.A O no hydrogen 2.722 N/A SER 13.A N GLN 9.A O no hydrogen 2.872 N/A ALA 14.A N SER 10.A O no hydrogen 2.823 N/A LEU 15.A N VAL 11.A O no hydrogen 2.851 N/A ASP 16.A N THR 12.A O no hydrogen 2.649 N/A ASN 17.A N SER 13.A O no hydrogen 2.816 N/A SER 18.A N ALA 14.A O no hydrogen 3.038 N/A SER 18.A OG ALA 14.A O no hydrogen 2.900 N/A LEU 19.A N LEU 15.A O no hydrogen 3.238 N/A ALA 20.A N ASP 16.A O no hydrogen 2.921 N/A LYS 21.A N ASN 17.A O no hydrogen 2.833 N/A LYS 21.A NZ GLU 164.A OE2 no hydrogen 3.355 N/A ASP 22.A N SER 18.A O no hydrogen 2.756 N/A THR 24.A N ASP 22.A OD1 no hydrogen 3.378 N/A ALA 25.A N ASP 22.A O no hydrogen 3.047 N/A VAL 26.A N THR 76.A O no hydrogen 2.992 N/A ILE 27.A N ARG 52.A O no hydrogen 2.661 N/A PHE 28.A N ILE 78.A O no hydrogen 3.250 N/A GLY 29.A N PHE 54.A O no hydrogen 3.394 N/A ALA 33.A N ASN 55.A OD1 no hydrogen 2.981 N/A GLY 35.A N VAL 32.A O no hydrogen 3.159 N/A ARG 39.A N GLY 36.A O no hydrogen 3.363 N/A ARG 39.A NE GLY 36.A O no hydrogen 3.292 N/A ARG 39.A NH2 GLY 36.A O no hydrogen 2.828 N/A THR 41.A N GLY 35.A O no hydrogen 2.816 N/A THR 41.A OG1 VAL 32.A O no hydrogen 2.433 N/A ARG 45.A NH1 VAL 53.A O no hydrogen 2.852 N/A ASP 46.A N GLY 43.A O no hydrogen 2.846 N/A LYS 47.A N GLY 43.A O no hydrogen 3.009 N/A LYS 47.A NZ ASP 16.A OD1 no hydrogen 3.346 N/A LYS 47.A NZ ASP 16.A OD2 no hydrogen 2.951 N/A TYR 48.A N LEU 44.A O no hydrogen 2.916 N/A TYR 48.A OH ASP 16.A OD1 no hydrogen 2.668 N/A GLY 49.A N ARG 45.A O no hydrogen 2.853 N/A ARG 52.A N GLY 49.A O no hydrogen 3.376 N/A ARG 52.A NH1 ASP 22.A O no hydrogen 3.075 N/A ARG 52.A NH1 ALA 25.A O no hydrogen 2.852 N/A ARG 52.A NH2 LEU 19.A O no hydrogen 2.879 N/A PHE 54.A N ILE 27.A O no hydrogen 3.007 N/A THR 56.A N GLY 29.A O no hydrogen 3.010 N/A THR 56.A OG1 PRO 57.A O no hydrogen 3.151 N/A CYS 59.A N PRO 57.A O no hydrogen 2.953 N/A GLY 62.A N CYS 59.A O no hydrogen 3.135 N/A ILE 63.A N CYS 59.A O no hydrogen 2.934 N/A VAL 64.A N GLU 60.A O no hydrogen 3.179 N/A GLY 65.A N GLN 61.A O no hydrogen 3.145 N/A PHE 66.A N GLY 62.A O no hydrogen 2.683 N/A GLY 67.A N ILE 63.A O no hydrogen 2.946 N/A ILE 68.A N VAL 64.A O no hydrogen 2.786 N/A GLY 69.A N GLY 65.A O no hydrogen 2.864 N/A ILE 70.A N PHE 66.A O no hydrogen 3.145 N/A ALA 71.A N GLY 67.A O no hydrogen 2.962 N/A VAL 72.A N ILE 68.A O no hydrogen 2.994 N/A THR 73.A N ILE 70.A O no hydrogen 2.759 N/A GLY 74.A N ALA 71.A O no hydrogen 2.621 N/A THR 76.A OG1 ASP 22.A OD2 no hydrogen 2.581 N/A ALA 77.A N SER 113.A O no hydrogen 2.848 N/A ILE 78.A N VAL 26.A O no hydrogen 2.832 N/A ALA 79.A N THR 115.A O no hydrogen 2.840 N/A GLU 80.A N PHE 28.A O no hydrogen 2.969 N/A ILE 81.A N ARG 117.A O no hydrogen 3.029 N/A GLN 82.A NE2 GLU 30.A O no hydrogen 3.292 N/A GLN 82.A NE2 ASP 31.A OD1 no hydrogen 3.092 N/A ALA 84.A N PRO 119.A O no hydrogen 2.842 N/A TYR 86.A N PHE 83.A O no hydrogen 2.818 N/A ILE 87.A N ALA 84.A O no hydrogen 3.302 N/A ALA 90.A N ILE 87.A O no hydrogen 3.016 N/A PHE 91.A N PHE 88.A O no hydrogen 2.962 N/A ILE 94.A N ALA 90.A O no hydrogen 2.970 N/A VAL 95.A N PHE 91.A O no hydrogen 2.878 N/A ASN 96.A N ASP 92.A O no hydrogen 2.904 N/A ALA 98.A N GLN 93.A O no hydrogen 3.141 N/A ALA 99.A N ILE 94.A O no hydrogen 2.932 N/A LYS 100.A N GLU 97.A O no hydrogen 2.734 N/A LYS 100.A NZ VAL 95.A O no hydrogen 2.933 N/A TYR 101.A N ALA 98.A O no hydrogen 3.245 N/A ARG 102.A NH1 ASP 107.A OD2 no hydrogen 2.905 N/A ARG 102.A NH2 LYS 166.A O no hydrogen 2.893 N/A ARG 104.A N LYS 100.A O no hydrogen 3.175 N/A ARG 104.A NH1 GLU 97.A OE1 no hydrogen 3.076 N/A ARG 104.A NH1 GLU 97.A OE2 no hydrogen 2.793 N/A ARG 104.A NH2 GLU 97.A OE1 no hydrogen 2.555 N/A SER 105.A N ARG 102.A O no hydrogen 3.003 N/A SER 105.A OG TYR 101.A O no hydrogen 3.465 N/A SER 105.A OG ARG 102.A O no hydrogen 3.160 N/A SER 105.A OG PHE 109.A O no hydrogen 2.961 N/A GLY 106.A N TYR 103.A O no hydrogen 3.264 N/A ASP 107.A N ARG 102.A O no hydrogen 3.163 N/A LEU 108.A N SER 105.A O no hydrogen 2.969 N/A LEU 108.A N SER 105.A OG no hydrogen 2.835 N/A PHE 109.A N SER 105.A OG no hydrogen 2.930 N/A CYS 111.A SG ALA 98.A O no hydrogen 3.626 N/A GLY 112.A N ASN 110.A OD1 no hydrogen 3.444 N/A SER 113.A OG ALA 71.A O no hydrogen 3.372 N/A SER 113.A OG ALA 75.A O no hydrogen 2.485 N/A LEU 114.A N CYS 111.A O no hydrogen 3.113 N/A THR 115.A N ALA 77.A O no hydrogen 2.790 N/A THR 115.A OG1 CYS 162.A O no hydrogen 3.428 N/A ILE 116.A N CYS 169.A O no hydrogen 2.977 N/A ARG 117.A N ALA 79.A O no hydrogen 2.884 N/A ARG 117.A NH1 GLU 173.A OE2 no hydrogen 2.554 N/A SER 118.A N PHE 171.A O no hydrogen 2.963 N/A SER 118.A OG ILE 81.A O no hydrogen 2.680 N/A TRP 120.A N GLU 173.A O no hydrogen 2.675 N/A GLY 121.A N GLN 132.A O no hydrogen 3.266 N/A CYS 122.A N GLU 264.A OE2 no hydrogen 2.953 N/A CYS 122.A SG GLU 306.A OE2 no hydrogen 3.555 N/A SER 131.A N ASP 85.A OD2 no hydrogen 3.016 N/A SER 131.A OG ALA 127.A O no hydrogen 2.897 N/A GLN 132.A N ASP 85.A OD2 no hydrogen 2.884 N/A GLN 132.A NE2 LEU 128.A O no hydrogen 3.331 N/A PHE 137.A N PRO 134.A O no hydrogen 2.797 N/A ALA 139.A N GLU 135.A O no hydrogen 3.232 N/A ALA 139.A N ALA 136.A O no hydrogen 3.126 N/A CYS 141.A N PHE 138.A O no hydrogen 3.103 N/A CYS 141.A SG PRO 142.A O no hydrogen 3.938 N/A LYS 145.A N PRO 168.A O no hydrogen 3.000 N/A LYS 145.A NZ ASP 165.A OD1 no hydrogen 2.747 N/A LYS 145.A NZ ASP 165.A OD2 no hydrogen 3.362 N/A VAL 147.A N ILE 170.A O no hydrogen 2.934 N/A ILE 148.A N ARG 239.A O no hydrogen 2.819 N/A ARG 150.A NH1 GLU 198.A OE2 no hydrogen 2.682 N/A ARG 150.A NH1 ASP 237.A OD2 no hydrogen 2.545 N/A ARG 150.A NH2 GLU 198.A OE1 no hydrogen 3.356 N/A ARG 150.A NH2 GLU 198.A OE2 no hydrogen 2.889 N/A SER 151.A OG GLU 183.A OE2 no hydrogen 3.151 N/A PHE 153.A N GLU 183.A OE2 no hydrogen 2.626 N/A ALA 155.A N SER 151.A O no hydrogen 2.760 N/A LYS 156.A N PRO 152.A O no hydrogen 3.262 N/A LYS 156.A NZ SER 13.A OG no hydrogen 2.692 N/A LYS 156.A NZ PRO 186.A O no hydrogen 2.635 N/A LYS 156.A NZ GLU 188.A O no hydrogen 3.190 N/A GLY 157.A N PHE 153.A O no hydrogen 3.317 N/A LEU 158.A N GLN 154.A O no hydrogen 2.925 N/A LEU 159.A N ALA 155.A O no hydrogen 2.784 N/A LEU 160.A N LYS 156.A O no hydrogen 3.061 N/A SER 161.A N GLY 157.A O no hydrogen 2.933 N/A SER 161.A OG GLY 157.A O no hydrogen 3.262 N/A SER 161.A OG ILE 192.A O no hydrogen 2.729 N/A CYS 162.A N LEU 158.A O no hydrogen 2.709 N/A CYS 162.A SG LEU 158.A O no hydrogen 3.390 N/A ILE 163.A N LEU 159.A O no hydrogen 2.765 N/A GLU 164.A N LEU 160.A O no hydrogen 3.156 N/A ASP 165.A N CYS 162.A O no hydrogen 3.108 N/A ASN 167.A ND2 ASP 165.A OD1 no hydrogen 3.171 N/A CYS 169.A N LEU 114.A O no hydrogen 3.299 N/A CYS 169.A SG ASN 167.A O no hydrogen 3.256 N/A ILE 170.A N LYS 145.A O no hydrogen 2.894 N/A PHE 171.A N ILE 116.A O no hydrogen 2.675 N/A PHE 172.A N VAL 147.A O no hydrogen 3.024 N/A GLU 173.A N SER 118.A O no hydrogen 2.881 N/A LYS 175.A N TRP 120.A O no hydrogen 2.983 N/A LYS 175.A NZ GLY 121.A O no hydrogen 2.600 N/A LYS 175.A NZ HIS 130.A O no hydrogen 2.704 N/A LEU 177.A N PRO 174.A O no hydrogen 3.034 N/A TYR 178.A N LYS 175.A O no hydrogen 3.258 N/A TYR 178.A OH GLU 173.A OE1 no hydrogen 2.528 N/A ALA 180.A N LEU 177.A O no hydrogen 3.168 N/A VAL 185.A N GLN 3.A O no hydrogen 2.764 N/A ILE 187.A N GLN 1.A O no hydrogen 3.029 N/A TYR 190.A OH PHE 153.A O no hydrogen 2.687 N/A ASN 191.A ND2 SER 161.A OG no hydrogen 3.165 N/A ASN 191.A ND2 GLU 164.A OE1 no hydrogen 2.468 N/A ILE 192.A N SER 161.A OG no hydrogen 3.034 N/A SER 195.A N THR 240.A OG1 no hydrogen 2.777 N/A SER 195.A OG PRO 243.A O no hydrogen 2.660 N/A ALA 197.A N ASP 245.A OD2 no hydrogen 2.669 N/A GLU 198.A N ASP 237.A O no hydrogen 2.861 N/A ILE 200.A N VAL 235.A O no hydrogen 3.141 N/A GLY 203.A N GLU 234.A OE2 no hydrogen 3.260 N/A SER 204.A N SER 232.A O no hydrogen 3.013 N/A SER 204.A OG ASP 205.A OD2 no hydrogen 2.797 N/A ASP 205.A N SER 232.A O no hydrogen 2.697 N/A VAL 206.A N SER 232.A O no hydrogen 3.337 N/A THR 207.A N ARG 258.A O no hydrogen 3.147 N/A THR 207.A OG1 SER 252.A OG no hydrogen 2.616 N/A LEU 208.A N GLU 234.A O no hydrogen 2.783 N/A VAL 209.A N LEU 260.A O no hydrogen 3.062 N/A ALA 210.A N ILE 236.A O no hydrogen 3.296 N/A TRP 211.A NE1 GLU 135.A OE2 no hydrogen 2.978 N/A GLN 214.A NE2 SER 262.A OG no hydrogen 3.313 N/A GLN 214.A NE2 PRO 311.A O no hydrogen 3.180 N/A VAL 215.A N GLY 212.A O no hydrogen 3.404 N/A HIS 216.A N THR 213.A O no hydrogen 3.042 N/A HIS 216.A NE2 ARG 150.A O no hydrogen 2.644 N/A ILE 218.A N GLN 214.A O no hydrogen 2.765 N/A ARG 219.A N VAL 215.A O no hydrogen 2.844 N/A GLU 220.A N HIS 216.A O no hydrogen 3.139 N/A VAL 221.A N VAL 217.A O no hydrogen 2.936 N/A ALA 222.A N ARG 219.A O no hydrogen 3.255 N/A SER 223.A N ARG 219.A O no hydrogen 3.364 N/A SER 223.A OG GLU 220.A OE1 no hydrogen 3.261 N/A MET 224.A N GLU 220.A O no hydrogen 3.015 N/A ALA 225.A N VAL 221.A O no hydrogen 2.888 N/A LYS 226.A N ALA 222.A O no hydrogen 3.191 N/A GLU 227.A N SER 223.A O no hydrogen 3.167 N/A LYS 228.A N MET 224.A O no hydrogen 2.643 N/A LYS 228.A N ALA 225.A O no hydrogen 3.348 N/A LEU 229.A N LYS 226.A O no hydrogen 3.262 N/A GLY 230.A N LYS 226.A O no hydrogen 2.500 N/A SER 232.A N ASP 205.A OD1 no hydrogen 3.136 N/A CYS 233.A SG VAL 231.A O no hydrogen 3.999 N/A GLU 234.A N VAL 206.A O no hydrogen 2.613 N/A VAL 235.A N GLN 201.A O no hydrogen 2.844 N/A ILE 236.A N LEU 208.A O no hydrogen 2.760 N/A ASP 237.A N GLU 198.A O no hydrogen 2.832 N/A LEU 238.A N ALA 210.A O no hydrogen 3.062 N/A ARG 239.A NH1 GLN 196.A O no hydrogen 3.227 N/A ARG 239.A NH2 GLN 154.A OE1 no hydrogen 2.898 N/A THR 240.A N LEU 238.A O no hydrogen 2.616 N/A ILE 241.A N VAL 146.A O no hydrogen 2.624 N/A VAL 246.A N TRP 244.A O no hydrogen 2.624 N/A THR 248.A N ASP 245.A OD1 no hydrogen 2.767 N/A THR 248.A OG1 ASP 245.A OD1 no hydrogen 2.871 N/A THR 248.A OG1 ASP 245.A OD2 no hydrogen 2.746 N/A CYS 250.A N VAL 246.A O no hydrogen 3.024 N/A CYS 250.A SG VAL 246.A O no hydrogen 3.215 N/A LYS 251.A N ASP 247.A O no hydrogen 2.809 N/A SER 252.A N THR 248.A O no hydrogen 3.301 N/A SER 252.A OG THR 207.A OG1 no hydrogen 2.616 N/A SER 252.A OG GLU 234.A OE1 no hydrogen 2.576 N/A VAL 253.A N ILE 249.A O no hydrogen 2.927 N/A ILE 254.A N CYS 250.A O no hydrogen 2.904 N/A LYS 255.A N LYS 251.A O no hydrogen 3.099 N/A LYS 255.A NZ GLU 234.A OE2 no hydrogen 2.577 N/A THR 256.A N SER 252.A O no hydrogen 2.827 N/A THR 256.A OG1 THR 207.A OG1 no hydrogen 3.217 N/A GLY 257.A N VAL 253.A O no hydrogen 2.460 N/A ARG 258.A NH1 ASP 205.A O no hydrogen 2.906 N/A LEU 260.A N THR 207.A O no hydrogen 3.096 N/A ILE 261.A N SER 292.A O no hydrogen 2.786 N/A SER 262.A N VAL 209.A O no hydrogen 2.991 N/A HIS 263.A N VAL 294.A O no hydrogen 3.247 N/A LEU 267.A N GLY 296.A O no hydrogen 3.046 N/A THR 268.A N ASP 298.A OD1 no hydrogen 2.918 N/A THR 268.A OG1 ASP 298.A OD1 no hydrogen 2.973 N/A THR 268.A OG1 ASP 298.A OD2 no hydrogen 2.649 N/A GLY 270.A N LEU 267.A O no hydrogen 2.819 N/A ALA 272.A N HIS 263.A NE2 no hydrogen 3.355 N/A SER 273.A N GLY 270.A O no hydrogen 3.200 N/A SER 273.A OG GLY 270.A O no hydrogen 3.382 N/A ILE 275.A N PHE 271.A O no hydrogen 3.405 N/A SER 276.A N ALA 272.A O no hydrogen 2.935 N/A SER 277.A N SER 273.A O no hydrogen 2.958 N/A SER 277.A OG SER 273.A O no hydrogen 2.781 N/A SER 277.A OG GLU 274.A O no hydrogen 3.124 N/A THR 278.A N GLU 274.A O no hydrogen 3.076 N/A THR 278.A OG1 GLU 274.A O no hydrogen 3.192 N/A THR 278.A OG1 GLU 274.A OE1 no hydrogen 3.089 N/A VAL 279.A N ILE 275.A O no hydrogen 2.784 N/A GLN 280.A N SER 276.A O no hydrogen 2.781 N/A GLN 280.A NE2 SER 277.A O no hydrogen 3.474 N/A GLU 281.A N SER 277.A O no hydrogen 3.380 N/A GLU 282.A N THR 278.A O no hydrogen 2.973 N/A CYS 283.A N VAL 279.A O no hydrogen 2.743 N/A CYS 283.A SG CYS 250.A O no hydrogen 3.430 N/A LEU 287.A N CYS 283.A O no hydrogen 3.185 N/A GLU 288.A N GLY 257.A O no hydrogen 2.634 N/A SER 292.A N LEU 259.A O no hydrogen 2.746 N/A VAL 294.A N ILE 261.A O no hydrogen 2.782 N/A GLY 296.A N HIS 263.A O no hydrogen 3.302 N/A GLY 296.A N ALA 265.A O no hydrogen 2.998 N/A THR 299.A N TYR 297.A O no hydrogen 2.727 N/A THR 299.A OG1 PRO 300.A O no hydrogen 3.168 N/A GLU 306.A N HIS 303.A O no hydrogen 3.516 N/A PHE 308.A N PHE 305.A O no hydrogen 2.808 N/A TYR 309.A N PHE 305.A O no hydrogen 2.999 N/A TYR 309.A N GLU 306.A O no hydrogen 2.819 N/A TYR 309.A OH TYR 297.A O no hydrogen 2.687 N/A ILE 310.A N GLU 306.A O no hydrogen 3.212 N/A LYS 315.A N ASP 312.A OD2 no hydrogen 2.812 N/A LYS 315.A NZ TYR 297.A OH no hydrogen 3.048 N/A LYS 315.A NZ PHE 308.A O no hydrogen 2.730 N/A LYS 315.A NZ TYR 309.A O no hydrogen 3.422 N/A LYS 315.A NZ ILE 310.A O no hydrogen 3.051 N/A CYS 316.A N ASP 312.A O no hydrogen 3.215 N/A CYS 316.A SG PRO 311.A O no hydrogen 3.575 N/A CYS 316.A SG ASP 312.A O no hydrogen 3.787 N/A TYR 317.A N LYS 313.A O no hydrogen 2.872 N/A ASP 318.A N TRP 314.A O no hydrogen 3.074 N/A ALA 319.A N LYS 315.A O no hydrogen 3.190 N/A LEU 320.A N CYS 316.A O no hydrogen 2.728 N/A ARG 321.A N TYR 317.A O no hydrogen 2.761 N/A LYS 322.A N ASP 318.A O no hydrogen 3.115 N/A MET 323.A N ALA 319.A O no hydrogen 3.173 N/A ILE 324.A N LEU 320.A O no hydrogen 2.903 N/A ASN 325.A N ARG 321.A O no hydrogen 2.748 N/A TYR 326.A N MET 323.A O no hydrogen 2.737 N/A